4-[4-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)oxy-3-nitro-phenyl]sulfonylmorpholine

Systemtic Name: 4-[4-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)oxy-3-nitro-phenyl]sulfonylmorpholine Openeye Name: 4-[4-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)oxy-3-nitro-phenyl]sulfonylmorpholine CAS Name: 4-[4-[(5,6-dimethyl-4-thieno[2,3-d]pyrimidinyl)oxy]-3-nitrophenyl]sulfonylmorpholine IUPAC Name: 4-[4-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)oxy-3-nitrophenyl]sulfonylmorpholine Traditional Name: 4-[4-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)oxy-3-nitro-phenyl]sulfonylmorpholine Formula: C18H18N4O6S2 MolecularWeight: 450.48872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)OC3=C(C=C(C=C3)S(=O)(=O)N4CCOCC4)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)OC3=C(C=C(C=C3)S(=O)(=O)N4CCOCC4)[N+](=O)[O-])C

InChI

InChI=1S/C18H18N4O6S2/c1-11-12(2)29-18-16(11)17(19-10-20-18)28-15-4-3-13(9-14(15)22(23)24)30(25,26)21-5-7-27-8-6-21/h3-4,9-10H,5-8H2,1-2H3